Geometry & MOs

Info

ID:	169998
PubChem CID:	75179160
Reduced:	O2H11C12 (2)
Stoich.:	A2B11C12 (2)
Weight, g/mol:	338.126657
ΔH_f, kcal/mol:	-100.47
Dipole, Da:	4.0
IP(EA), eV:	-8.82(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-anilino-4-oxo-2-(3-phenylprop-2-enoylamino)butanoic acid

Drug info:

PubChemData

Smile

CC(=O)OC1CC2=CC=CC=C2OC1C3=CC=C(C=C3)OCC4=CC=CC=C4

DOS

IR

Vibrations